Home Nitriles 3-cyclopropyl-4-methoxybut-2-enenitrile

3-cyclopropyl-4-methoxybut-2-enenitrile

CAS No.:
1563821-57-7
Catalog Number:
AG01ELX6
Molecular Formula:
C8H11NO
Molecular Weight:
137.1790
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Product Description
Catalog Number:
AG01ELX6
Chemical Name:
3-cyclopropyl-4-methoxybut-2-enenitrile
CAS Number:
1563821-57-7
Molecular Formula:
C8H11NO
Molecular Weight:
137.1790
MDL Number:
MFCD23893462
IUPAC Name:
(Z)-3-cyclopropyl-4-methoxybut-2-enenitrile
InChI:
InChI=1S/C8H11NO/c1-10-6-8(4-5-9)7-2-3-7/h4,7H,2-3,6H2,1H3/b8-4+
InChI Key:
AYCJCLXTNJTIGW-XBXARRHUSA-N
SMILES:
COCC(=CC#N)C1CC1
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
137.084g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
137.182g/mol
Monoisotopic Mass:
137.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties